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Substance Name: (4E,15Z,26E)-Triaconta-4,15,26-triene-1,12,18,29-tetrayne-3,14,17,28-tetraol
RN: 111554-19-9
InChIKey: XSMIHZSZZNCCEL-QDAXDSGISA-N

Molecular Formula

  • C30-H40-O4

Molecular Weight

  • 464.642
 
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Names and Synonyms

Synonym

  • Petrosynol

Systematic Name

  • (4E,15Z,26E)-Triaconta-4,15,26-triene-1,12,18,29-tetrayne-3,14,17,28-tetraol

Registry Numbers

CAS Registry Number

  • 111554-19-9

System Generated Number

  • 0111554199

Structure Descriptors

InChI

1S/C30H40O4/c1-3-27(31)21-17-13-9-5-7-11-15-19-23-29(33)25-26-30(34)24-20-16-12-8-6-10-14-18-22-28(32)4-2/h1-2,17-18,21-22,25-34H,5-16H2/b21-17+,22-18+,26-25-/t27-,28-,29-,30+/m1/s1

InChIKey

XSMIHZSZZNCCEL-QDAXDSGISA-N

Smiles

C#C[C@@H](O)/C=C/CCCCCCC#C[C@H](O)/C=C\[C@H](O)C#CCCCCCC/C=C/[C@H](O)C#C